CID 9570428

4'-methoxy-2-((4-methyl-1-piperazinyl)imino)acetophenone hydrochloride

Structural Information

Molecular Formula
C14H19N3O2
SMILES
CN1CCN(CC1)/N=C/C(=O)C2=CC=C(C=C2)OC
InChI
InChI=1S/C14H19N3O2/c1-16-7-9-17(10-8-16)15-11-14(18)12-3-5-13(19-2)6-4-12/h3-6,11H,7-10H2,1-2H3/b15-11+
InChIKey
SRIIEXBDHZFNFH-RVDMUPIBSA-N
Compound name
(2E)-1-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)iminoethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.14774 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.15502 161.1
[M+Na]+ 284.13696 166.3
[M-H]- 260.14046 165.6
[M+NH4]+ 279.18156 175.1
[M+K]+ 300.11090 163.9
[M+H-H2O]+ 244.14500 151.4
[M+HCOO]- 306.14594 180.9
[M+CH3COO]- 320.16159 200.8
[M+Na-2H]- 282.12241 164.6
[M]+ 261.14719 159.6
[M]- 261.14829 159.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.